[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]ammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methyl-[2-(3,4-dimethoxyphenyl)ethyl]azanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-3-methoxy-benzyl]-homoveratryl-ammonium Formula: C20H27N2O5+ MolecularWeight: 375.43878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC(=C(C=C2)OCC(=O)N)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=CC(=C(C=C2)OCC(=O)N)OC)OC

InChI

InChI=1S/C20H26N2O5/c1-24-16-6-4-14(10-18(16)25-2)8-9-22-12-15-5-7-17(19(11-15)26-3)27-13-20(21)23/h4-7,10-11,22H,8-9,12-13H2,1-3H3,(H2,21,23)/p+1